- InChI
- InChI=1S/C28H38O4/c1-4-5-6-7-8-9-10-11-12-13-19-31-27(29)24-15-14-16-25(21-24)28(30)32-26-18-17-22(2)23(3)20-26/h14-18,20-21H,4-13,19H2,1-3H3
- InChI Key
- IJWPDSUYBAEQLY-UHFFFAOYSA-N
- Formula
- C28H38O4
- SMILES
-
CCCCCCCCCCCCOC(=O)c1cccc(C(=O)
Oc2ccc(C)c(C)c2)c1 - Molecular Weight1
- 438.60
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -87.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -672.20 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 60.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 102.77 | kJ/mol | Joback Calculated Property |
| log10WS | -9.36 | Crippen Calculated Property | |
| logPoct/wat | 7.600 | Crippen Calculated Property | |
| McVol | 372.740 | ml/mol | McGowan Calculated Property |
| Pc | 978.40 | kPa | Joback Calculated Property |
| Inp | 3523.00 | NIST | |
| Tboil | 1060.92 | K | Joback Calculated Property |
| Tc | 1298.92 | K | Joback Calculated Property |
| Tfus | 640.04 | K | Joback Calculated Property |
| Vc | 1.435 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1258.28; 1320.48] | J/mol×K | [1060.92; 1298.92] | 
|
| Cp,gas | 1258.28 | J/mol×K | 1060.92 | Joback Calculated Property |
| Cp,gas | 1272.66 | J/mol×K | 1100.59 | Joback Calculated Property |
| Cp,gas | 1285.36 | J/mol×K | 1140.25 | Joback Calculated Property |
| Cp,gas | 1296.42 | J/mol×K | 1179.92 | Joback Calculated Property |
| Cp,gas | 1305.92 | J/mol×K | 1219.59 | Joback Calculated Property |
| Cp,gas | 1313.92 | J/mol×K | 1259.26 | Joback Calculated Property |
| Cp,gas | 1320.48 | J/mol×K | 1298.92 | Joback Calculated Property |
| η | [0.0000185; 0.0001715] | Pa×s | [640.04; 1060.92] |
|
| η | 0.0001715 | Pa×s | 640.04 | Joback Calculated Property |
| η | 0.0000984 | Pa×s | 710.19 | Joback Calculated Property |
| η | 0.0000624 | Pa×s | 780.33 | Joback Calculated Property |
| η | 0.0000427 | Pa×s | 850.48 | Joback Calculated Property |
| η | 0.0000309 | Pa×s | 920.63 | Joback Calculated Property |
| η | 0.0000235 | Pa×s | 990.77 | Joback Calculated Property |
| η | 0.0000185 | Pa×s | 1060.92 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Isophthalic acid, 3,4-dimethylphenyl dodecyl ester.
Sources
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